ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008396
RECORD_TITLE: ETHYL GERANYL ACETONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: ETHYL GERANYL ACETONE
CH$NAME: 6,10-DIMETHYL-5,9-DODECADIEN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₄O
CH$EXACT_MASS: 208.18272
CH$SMILES: CCC(C)=CCCC(C)=CCCC(C)=O
CH$IUPAC: InChI=1S/C14H24O/c1-5-12(2)8-6-9-13(3)10-7-11-14(4)15/h8,10H,5-7,9,11H2,1-4H3/b12-8+,13-10+
CH$LINK: INCHIKEY HSRQHSFPIKREMB-SDCOAONHSA-N

AC$INSTRUMENT: HITACHI M-80B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9100000000-82e272b37dbeca6a080e
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  15 1.72 17
  27 5.39 54
  29 5.62 56
  39 9.02 90
  41 26.56 266
  42 2.04 20
  43 99.99 999
  44 2.11 21
  53 5.66 57
  54 1.36 14
  55 53.31 533
  56 2.63 26
  58 2.14 21
  65 1.81 18
  67 11.83 118
  68 2.81 28
  69 2.18 22
  71 2.05 21
  77 2.17 22
  79 2.71 27
  81 4.95 50
  82 6.41 64
  83 31.71 317
  84 2.37 24
  91 1.77 18
  93 4.93 49
  94 1.14 11
  95 2.87 29
  107 7.92 79
  108 2.44 24
  109 1.58 16
  111 1.1 11
  121 2.38 24
  123 2.59 26
  125 10.17 102
  126 1.13 11
  135 1.42 14
  138 1.14 11
  150 5.57 56
  151 9.83 98
  152 1.1 11
  208 1.5 15
//